6-[4-cyano-5-(2-methylbutylamino)-3-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide

Systemtic Name: 6-[4-cyano-5-(2-methylbutylamino)-3-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide Openeye Name: 6-[4-cyano-5-(2-methylbutylamino)-3-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide CAS Name: 6-[4-cyano-5-(2-methylbutylamino)-3-(trifluoromethyl)-1-pyrazolyl]-3-pyridinesulfonamide IUPAC Name: 6-[4-cyano-5-(2-methylbutylamino)-3-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide Traditional Name: 6-[4-cyano-5-(2-methylbutylamino)-3-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide Formula: C15H17F3N6O2S MolecularWeight: 402.39469

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CNC1=C(C(=NN1C2=NC=C(C=C2)S(=O)(=O)N)C(F)(F)F)C#N

Isomeric SMILES

CCC(C)CNC1=C(C(=NN1C2=NC=C(C=C2)S(=O)(=O)N)C(F)(F)F)C#N

InChI

InChI=1S/C15H17F3N6O2S/c1-3-9(2)7-22-14-11(6-19)13(15(16,17)18)23-24(14)12-5-4-10(8-21-12)27(20,25)26/h4-5,8-9,22H,3,7H2,1-2H3,(H2,20,25,26)